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Traditional approaches to elucidation of protein structures by NMR spectroscopy rely on distance restraints also known as nuclear Overhauser effects (NOEs). The use of NOEs as the primary source of structure determination by NMR…

Biomolecules · Quantitative Biology 2019-11-21 Casey A Cole , Caleb Parks , Julian Rachele , Homayoun Valafar

Protein structure reconstruction from Nuclear Magnetic Resonance (NMR) experiments largely relies on computational algorithms. Recently, some effective low-rank matrix completion (MC) methods, such as ASD and ScaledASD, have been…

Biological Physics · Physics 2018-09-24 Z. Li , S. Li , X. Wei , X. Peng , Q. Zhao

The current paradigm for protein structure determination by NMR spectroscopy has thus far been based on collecting distance restrains between pairs of nuclei in the form of nuclear Overhauser enhancements (NOE). These, have in some…

Chemical Physics · Physics 2020-02-05 Inês Trindade , Michele Invernici , Francesca Cantini , Ricardo O Louro , Mario Piccioli

In this article, we are interested in developing polynomial decomposition techniques based on sums-of-squares (SOS), namely the difference-of-sums-of-squares (D-SOS) and the difference-of-convex-sums-of-squares (DC-SOS). In particular, the…

Optimization and Control · Mathematics 2024-02-21 Yi-Shuai Niu , Hoai An Le Thi , Dinh Tao Pham

We propose a novel methodology for solving a two-stage adjustable robust convex optimisation problem with a general (proximable) convex objective function and constraints defined by sum-of-squares (SOS) convex polynomials. These problems…

Optimization and Control · Mathematics 2026-02-17 Neil D. Dizon , Bethany I. Caldwell , Vaithilingam Jeyakumar , Guoyin Li

Traditional approaches to elucidation of protein structures by NMR spectroscopy rely on distance restraints also know as nuclear Overhauser effects (NOEs). The use of NOEs as the primary source of structure determination by NMR spectroscopy…

Biomolecules · Quantitative Biology 2020-01-10 Casey A. Cole , Daniela Ishimaru , Mirko Hennig , Homayoun Valafar

Continuous optimization is an important problem in many areas of AI, including vision, robotics, probabilistic inference, and machine learning. Unfortunately, most real-world optimization problems are nonconvex, causing standard convex…

Artificial Intelligence · Computer Science 2016-11-10 Abram L. Friesen , Pedro Domingos

We aim to find a solution $\bm{x}\in\mathbb{C}^n$ to a system of quadratic equations of the form $b_i=\lvert\bm{a}_i^*\bm{x}\rvert^2$, $i=1,2,\ldots,m$, e.g., the well-known NP-hard phase retrieval problem. As opposed to recently proposed…

Optimization and Control · Mathematics 2019-05-28 Ji Li , Jian-Feng Cai , Hongkai Zhao

Semidefinite Programming (SDP) and Sums-of-Squares (SOS) relaxations have led to certifiably optimal non-minimal solvers for several robotics and computer vision problems. However, most non-minimal solvers rely on least-squares…

Computer Vision and Pattern Recognition · Computer Science 2020-06-15 Heng Yang , Pasquale Antonante , Vasileios Tzoumas , Luca Carlone

Residual Dipolar Couplings (RDCs) acquired by Nuclear Magnetic Resonance (NMR) spectroscopy can be an indispensable source of information in investigation of molecular structures and dynamics. Here we present a complete strategy for…

Numerical Analysis · Mathematics 2021-03-22 Casey A. Cole , Rishi Mukhapadhyay , Hanin Omar , Mirko Hennig , Homayoun Valafar

This paper concerns the problem of recovering an unknown but structured signal $x \in R^n$ from $m$ quadratic measurements of the form $y_r=|<a_r,x>|^2$ for $r=1,2,...,m$. We focus on the under-determined setting where the number of…

Machine Learning · Computer Science 2017-02-22 Mahdi Soltanolkotabi

We present a hierarchy of semidefinite programs (SDPs) for the problem of fitting a shape-constrained (multivariate) polynomial to noisy evaluations of an unknown shape-constrained function. These shape constraints include convexity or…

Optimization and Control · Mathematics 2022-10-31 Mihaela Curmei , Georgina Hall

Correspondence problems are often modelled as quadratic optimization problems over permutations. Common scalable methods for approximating solutions of these NP-hard problems are the spectral relaxation for non-convex energies and the…

Graphics · Computer Science 2017-05-18 Nadav Dym , Haggai Maron , Yaron Lipman

When sum-of-squares (SOS) programs are recast as semidefinite programs (SDPs) using the standard monomial basis, the constraint matrices in the SDP possess a structural property that we call \emph{partial orthogonality}. In this paper, we…

Optimization and Control · Mathematics 2020-01-13 Yang Zheng , Giovanni Fantuzzi , Antonis Papachristodoulou

Sum of squares (SOS) optimization is a powerful technique for solving problems where the positivity of a polynomials must be enforced. The common approach to solve an SOS problem is by relaxation to a Semidefinite Program (SDP). The main…

Optimization and Control · Mathematics 2024-10-29 Daniel Keren , Margarita Osadchy , Roi Poranne

This paper explores the non-convex composition optimization in the form including inner and outer finite-sum functions with a large number of component functions. This problem arises in some important applications such as nonlinear…

Machine Learning · Statistics 2017-11-15 Liu Liu , Ji Liu , Dacheng Tao

The compressive sensing (CS) and 1-bit CS demonstrate superior efficiency in signal acquisition and resource conservation, while 1-bit CS achieves maximum resource efficiency through sign-only measurements. With the emergence of massive…

Methodology · Statistics 2025-05-06 Erbo Li , Qi Qin , Yifan Sun , Liping Zhu

A novel approach for structure alignment is presented, where the key ingredients are: (1) An error function formulation of the problem simultaneously in terms of binary (Potts) assignment variables and real-valued atomic coordinates. (2)…

Biological Physics · Physics 2007-05-23 M. Ohlsson , C. Peterson , M. Ringner , R. Blankenbecler

Estimating unknown rotations from noisy measurements is an important step in SfM and other 3D vision tasks. Typically, local optimization methods susceptible to returning suboptimal local minima are used to solve the rotation averaging…

Computer Vision and Pattern Recognition · Computer Science 2019-06-17 Matthew Giamou , Filip Maric , Valentin Peretroukhin , Jonathan Kelly

Consider $N$ points in $\mathbb{R}^d$ and $M$ local coordinate systems that are related through unknown rigid transforms. For each point we are given (possibly noisy) measurements of its local coordinates in some of the coordinate systems.…

Computer Vision and Pattern Recognition · Computer Science 2014-12-24 Kunal N. Chaudhury , Yuehaw Khoo , Amit Singer
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